SMILES:
COc1cc(I)ccc1Oc1ccc(Cl)c(Cl)c1Molecular Processing
Molecular formula
C13H9Cl2IO2
Molecular weight
395.02
Exact mass
393.9024
XLogP
5.4
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
82.25
Supplementary Information
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